1-Butan-2-yl-3-(4-chlorophenyl)urea
TL;DR: 1-Butan-2-yl-3-(4-chlorophenyl)urea (CAS 5154-41-6) is a chemical compound with molecular formula C11H15ClN2O and molecular weight 226.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butan-2-yl-3-(4-chlorophenyl)urea
Also Known As: 1-butan-2-yl-3-(4-chlorophenyl)urea, N-(sec-butyl)-N'-(4-chlorophenyl)urea, 3-(butan-2-yl)-1-(4-chlorophenyl)urea, BIM-0011521.P001, N-(Butan-2-yl)-N'-(4-chlorophenyl)urea
| Molecular Formula | C11H15ClN2O |
|---|---|
| Molecular Weight | 226.09 g/mol |
| LogP | 3.26 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 226.0873 |
| Heavy Atoms | 15 |
| Complexity | 323.86475 |
Chemical Identifiers
| CAS Number | 5154-41-6 |
|---|---|
| SMILES | CCC(C)NC(=O)NC1=CC=C(C=C1)Cl |
Product Overview
1-Butan-2-yl-3-(4-chlorophenyl)urea (CAS 5154-41-6), with molecular formula C11H15ClN2O and molecular weight 226.09 g/mol. IUPAC: 1-butan-2-yl-3-(4-chlorophenyl)urea.
Chemical Property Profile of 1-Butan-2-yl-3-(4-chlorophenyl)urea
Property Insights of 1-Butan-2-yl-3-(4-chlorophenyl)urea
The XLogP value of 3.26 indicates that 1-Butan-2-yl-3-(4-chlorophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 1-Butan-2-yl-3-(4-chlorophenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butan-2-yl-3-(4-chlorophenyl)urea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Butan-2-yl-3-(4-chlorophenyl)urea?
The CAS number of 1-Butan-2-yl-3-(4-chlorophenyl)urea is 5154-41-6.
What is the molecular formula of 1-Butan-2-yl-3-(4-chlorophenyl)urea?
The molecular formula of 1-Butan-2-yl-3-(4-chlorophenyl)urea is C11H15ClN2O.
What is the molecular weight of 1-Butan-2-yl-3-(4-chlorophenyl)urea?
The molecular weight of 1-Butan-2-yl-3-(4-chlorophenyl)urea is 226.09 g/mol.
Where can I buy 1-Butan-2-yl-3-(4-chlorophenyl)urea?
You can request a quote for 1-Butan-2-yl-3-(4-chlorophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butan-2-yl-3-(4-chlorophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-Butan-2-yl-3-(4-chlorophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.